Glycoside
GD036776
Name:
NoneFormula:
C30H36O13Smiles:
C=CCc1ccc(O[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)c(-c2cc(CC=C)ccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
C=CCc1ccc(O)c(-c2cc(CC=C)ccc2O)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.43 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 11 |
| MolWt: | 604.61 | Num_heavy_atoms: | 43 |
| TPSA: | 215.83 | NumAromaticRings: | 2 |
Unique Aglycone
AD05660
Formula: C18H18O2
Smiles:
C=CCc1ccc(O)c(-c2cc(CC=C)ccc2O)c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 4.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 266.34 | Num_heavy_atoms: | 20 |
| TPSA: | 40.46 | NumAromaticRings: | 2 |
